Octyl isobutyrate

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Catalog Number ACM109159-1
Product Name Octyl isobutyrate
CAS Number 109-15-9
Structure Octyl isobutyrate
IUPAC Name Octyl 2-methylpropanoate
Synonyms Caprylyl isobutyrate
Molecular Weight 200.32
Molecular Formula C12H24O2
Canonical SMILES CCCCCCCCOC(=O)C(C)C
Inchi InChI=1S/C12H24O2/c1-4-5-6-7-8-9-10-14-12(13)11(2)3/h11H,4-10H2,1-3H3
InChIKey PQCYCHFQWMNQRJ-UHFFFAOYSA-N
Boiling Point 245 °C
Melting Point -56 °C
Flash Point 206 °F
Purity 95%+
Density 0.856 g/mL at 25 °C(lit.)
Solubility water, 4.064 mg/L @ 25 °C (est)
Appearance Colorless to pale yellow clear liquid
Physical State Liquid
Refractive Index n20/D 1.421(lit.)

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